Name | Value |
---|---|
DTUQWGWMVIHBKE-UHFFFAOYSA-N | |
C8H8O | |
120.057514876 | |
O=CCC=1C=CC=CC1 | |
InChI=1S/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2 |
Name | Value |
---|---|
M + 0 | |
positive | |
1108 | |
HCD (NCE 20-30-40%) | |
5.585834 | |
LC-ESI-QFT | |
Thermo Q Exactive HF | |
Michael Sa and Megan Showalter | |
MS2 | |
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm) | |
1.7757665611976639 | |
0.7146210346972846 | |
121.065 | |
[M+H]+ | |
4.005088175786374 ppm | |
-4.8487600000157727E-4 Da |